SCHEMBL10000533

SCHEMBL10000533

c1ccc2c(c1)sc1c3sc(-c4cc5sc6c7ccccc7sc6c5s4)cc3sc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.46
MAPT P10636 5/20 0.40
RAB9A P51151 5/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ALDH1A1 P00352 6/20 0.38
HPGD P15428 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ALOX15 P16050 2/20 0.37
LMNA P02545 2/20 0.37
NPC1 O15118 2/20 0.37
GLA P06280 1/20 0.37
TSHR P16473 1/20 0.37
ALOX12 P18054 1/20 0.37
PTPN2 P17706 1/20 0.37
PTPN1 P18031 1/20 0.37
LIMK1 P53667 1/20 0.37
CDK5 Q00535 1/20 0.37
CDK5R1 Q15078 1/20 0.37
L3MBTL1 Q9Y468 3/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL10000535 0.89 NQO1 (0.45) GPR3MAPT
SCHEMBL10000529 0.89 CYP1A1 (0.44) GPR3MAPTRAB9AMEN1KMT2A
SCHEMBL23046395 0.87 MAPT (0.42) GPR3MAPTRAB9AMEN1KMT2A
SCHEMBL20662900 0.86 CYP1A1 (0.42) GPR3MAPTRAB9AALDH1A1HPGD
SCHEMBL10000532 0.84 GPR3 (0.36) GPR3MAPTRAB9AMEN1KMT2A
SCHEMBL23046398 0.83 TNKS (0.43) GPR3MAPTRAB9AMEN1KMT2A
SCHEMBL349784 0.82 GPR3 (0.60) GPR3MAPTRAB9AMEN1KMT2A
SCHEMBL29700327 0.82 GPR3 (0.67) GPR3MAPTRAB9AMEN1KMT2A
SCHEMBL430470 0.82 GPR3 (0.67) GPR3MAPTRAB9AMEN1KMT2A
SCHEMBL10000530 0.80 ALDH1A1 (0.52) GPR3MAPTRAB9AMEN1KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8350256-B2 Organic semiconductor compounds INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2013-01-08 US disclosed
US-8350256-B2 Organic semiconductor compounds INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2013-01-08 US disclosed
US-20120012819-A1 ORGANIC SEMICONDUCTOR COMPOUNDS INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2012-01-19 US disclosed
US-20120012819-A1 ORGANIC SEMICONDUCTOR COMPOUNDS INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2012-01-19 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120012819-A1 ORGANIC SEMICONDUCTOR COMPOUNDS TST, TPST2, BHMT2 GPR3 3305/4885MAPT 1628/4885RAB9A 4008/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.